cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone

C15H22N2O2 — CID 53017115

IUPACcyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
SMILESCc1cc(C2CCCN2C(=O)C2CCCCC2)no1
InChIInChI=1S/C15H22N2O2/c1-11-10-13(16-19-11)14-8-5-9-17(14)15(18)12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3
InChIKeySQPAMSBPKVTAQE-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.23
Rot. Bonds2

About cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone

cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone (PubChem CID 53017115) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Namecyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
PubChem CID53017115
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Namecyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
SMILESCc1cc(C2CCCN2C(=O)C2CCCCC2)no1
InChIInChI=1S/C15H22N2O2/c1-11-10-13(16-19-11)14-8-5-9-17(14)15(18)12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3
InChIKeySQPAMSBPKVTAQE-UHFFFAOYSA-N
XLogP3.23
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone?
The IUPAC name of cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone (CID 53017115) is cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone?
The canonical SMILES for cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone is Cc1cc(C2CCCN2C(=O)C2CCCCC2)no1.
What is the InChIKey of cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone?
The InChIKey is SQPAMSBPKVTAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-10-13(16-19-11)14-8-5-9-17(14)15(18)12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3.
What are the key properties of cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone?
cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone has a molecular weight of 262.35 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 53017115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).